Chem
J-GLOBAL ID:200907076302663706
Nikkaji number:J2.567.480D
(4bS)-2-Methoxy-4bα,8,8-trimethyl-4b,5,6,7,8,8a,9,10-octahydrophenanthrene-1-carboxylic acid methyl ester
(4bS)-2-メトキシ-4bα,8,8-トリメチル-4b,5,6,7,8,8a,9,10-オクタヒドロフェナントレン-1-カルボン酸メチル
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C20 H28 O3
Molecular formula furigana:
C20-H28-O3
Molecular weight:
316.441
InChI:
InChI=1S/C20H28O3/c1-19(2)11-6-12-20(3)14-8-9-15(22-4)17(18(21)23-5)13(14)7-10-16(19)20/h8-9,16H,6-7,10-12H2,1-5H3/t16?,20-/m1/s1
InChI key:
CFKNODFZVDBSJO-OTOKDRCRSA-N
SMILES:
COC(=O)c1c(OC)ccc2c1CCC1C(C)(C)CCC[C@]21C
Systematic name (3):
(4bS)-2-メトキシ-4bα,8,8-トリメチル-4b,5,6,7,8,8a,9,10-オクタヒドロフェナントレン-1-カルボン酸メチル
メチル (4bS)-2-メトキシ-4b,8,8-トリメチル-4b,5,6,7,8,8a,9,10-オクタヒドロフェナントレン-1-カルボキシラート
methyl (4bS)-2-methoxy-4b,8,8-trimethyl-4b,5,6,7,8,8a,9,10-octahydrophenanthrene-1-carboxylate
Other name (1):
(4bS)-2-Methoxy-4bα,8,8-trimethyl-4b,5,6,7,8,8a,9,10-octahydrophenanthrene-1-carboxylic acid methyl ester
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